Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D08ORM
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| Former ID |
DNC009070
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| Drug Name |
Ac-VEID-CHO
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| Synonyms |
Ac-VEID-CHO; CHEMBL478081; Ac-Val-Glu-Ile-Asp-CHO; acetyl-Val-Ile-Asp-aldehyde; GTPL8566; SCHEMBL20257260; acetyl-Val-Glu-Ile-Asp-aldehyde; N-acetyl-Val-Glu-Ile-Asp-aldehyde; ZINC14947179; BDBM50340548; 319494-39-8; N-Acetyl-Val-Glu-Ile-Asp-al, ~99% (HPLC), powder; (4S)-4-[[(2S)-2-acetamido-3-methylbutanoyl]amino]-5-[[(2S,3S)-1-[[(2S)-1-carboxy-3-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-5-oxopentanoic acid
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C22H36N4O9
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| Canonical SMILES |
CCC(C)C(C(=O)NC(CC(=O)O)C=O)NC(=O)C(CCC(=O)O)NC(=O)C(C(C)C)NC(=O)C
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| InChI |
1S/C22H36N4O9/c1-6-12(4)19(22(35)24-14(10-27)9-17(31)32)26-20(33)15(7-8-16(29)30)25-21(34)18(11(2)3)23-13(5)28/h10-12,14-15,18-19H,6-9H2,1-5H3,(H,23,28)(H,24,35)(H,25,34)(H,26,33)(H,29,30)(H,31,32)/t12-,14-,15-,18-,19-/m0/s1
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| InChIKey |
KYUFGGNCJRWMDN-GOYXDOSHSA-N
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| PubChem Compound ID | ||||
| PubChem Substance ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Caspase 6 messenger RNA (CASP6 mRNA) | Target Info | Inhibitor | [2] |
| KEGG Pathway | Apoptosis | |||
| NetPath Pathway | TCR Signaling Pathway | |||
| Panther Pathway | FAS signaling pathway | |||
| Pathway Interaction Database | Direct p53 effectors | |||
| p75(NTR)-mediated signaling | ||||
| C-MYB transcription factor network | ||||
| HIV-1 Nef: Negative effector of Fas and TNF-alpha | ||||
| Caspase Cascade in Apoptosis | ||||
| Reactome | Apoptotic cleavage of cellular proteins | |||
| Caspase-mediated cleavage of cytoskeletal proteins | ||||
| WikiPathways | Apoptosis Modulation by HSP70 | |||
| FAS pathway and Stress induction of HSP regulation | ||||
| Apoptosis | ||||
| Parkinsons Disease Pathway | ||||
| Apoptotic execution phase | ||||
| Apoptosis Modulation and Signaling | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 8566). | |||
| REF 2 | Synthesis and in vitro evaluation of sulfonamide isatin Michael acceptors as small molecule inhibitors of caspase-6. J Med Chem. 2009 Apr 23;52(8):2188-91. | |||
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